smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1nc([N+](=O)[O-])cc1C[NH+]1CCCC1	ZINC000685936706	538756942	/nfs/dbraw/zinc/75/69/42/538756942.db2.gz	RQVNPPZYWVLNRH-UHFFFAOYSA-N	1	1	210.237	0.924	40	5		BCBBMO
C[N@@H+]1C[C@@]2([N+](=O)[O-])C=CC[C@@]([N+](=O)[O-])(C1)C2	ZINC000001757066	173190698	/nfs/dbraw/zinc/19/06/98/173190698.db2.gz	UJTVOFSDBXXRSP-BDAKNGLRSA-N	1	1	227.220	0.313	40	5		BCBBMO
C[N@H+]1CCc2[nH]c(=O)c([N+](=O)[O-])cc2C1	ZINC000096510600	385250609	/nfs/dbraw/zinc/25/06/09/385250609.db2.gz	XNXLNESVXBNHJF-UHFFFAOYSA-N	1	1	209.205	0.271	40	5		BCBBMO
COC(=O)[C@@H]([NH3+])Cc1cccc([N+](=O)[O-])c1	ZINC000069553390	388723456	/nfs/dbraw/zinc/72/34/56/388723456.db2.gz	LXNVQGBXSRKLSX-VIFPVBQESA-N	1	1	224.216	0.638	40	5		BCBBMO